S-Methyl methanethiosulfonate - CAS 2949-92-0

Catalog:	BB020220
Product Name:	S-Methyl methanethiosulfonate
CAS:	2949-92-0
Synonyms:	methylsulfonylsulfanylmethane

Technical Data

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Computed Properties

IUPAC Name:	methylsulfonylsulfanylmethane
Description:	Used for the rapid and selective modification of sulfhydryl groups of enzymes. Useful for mapping the pore-lining regions of the ryanodine receptor.
Molecular Weight:	126.20
Molecular Formula:	C2H6O2S2
Canonical SMILES:	CSS(=O)(=O)C
InChI:	InChI=1S/C2H6O2S2/c1-5-6(2,3)4/h1-2H3
InChI Key:	XYONNSVDNIRXKZ-UHFFFAOYSA-N
Boiling Point:	69-71 °C (0.4 mmHg)
Density:	1.337 g/cm³
Solubility:	slightly
Appearance:	Clear yellow liquid with a stench
MDL:	MFCD00007565
LogP:	1.38980

Publication Number	Title	Priority Date
CN-112881690-A	Respiratory syncytial virus related protein marker TPI1 and detection kit	20210204
CN-112881690-B	Respiratory syncytial virus related protein marker TPI1 and detection kit	20210204
CN-112220791-A	Application of CYR61 protein sulfhydryl nitrosylation modification site	20201125
CN-112098640-A	Fluorescent protein and/or coupled protein monoclonal antibody marking method and kit thereof	20200916
CN-112034182-A	Method and system for predicting colon cancer metastasis	20200901

PMID	Publication Date	Title	Journal
22832011	20121101	Interaction of S-methyl methanethiosulfonate with DPPC bilayer	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
22837314	20121101	Cysteine residues in the transmembrane (TM) 9 to TM11 region of the human equilibrative nucleoside transporter subtype 1 play an important role in inhibitor binding and translocation function	Molecular pharmacology
22741521	20120724	Catalytic zinc site and mechanism of the metalloenzyme PR-AMP cyclohydrolase	Biochemistry
22345640	20120501	The cyclic nucleotide cGMP is involved in plant hormone signalling and alters phosphorylation of Arabidopsis thaliana root proteins	Journal of experimental botany
22342510	20120401	Cloning, overexpression and characterization of Leishmania donovani triosephosphate isomerase	Experimental parasitology

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Related Functional Groups

Carbonyl Compounds

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DBCO-PEG4-NHS ester
[959574-98-2]
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[1035840-45-9]
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2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Sulfur Compounds

[2006276-82-8]
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[6633-90-5]
1,4-Butanedithiol diacetate
[1778-09-2]
4'-(Methylthio)acetophenone
[1879-16-9]
4-Methoxythioanisole
[1005651-99-9]
5-[(5-Methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
[21124-33-4]
Ammonium diethyldithiocarbamate

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GHS Hazard Statement:	H315 (96.54%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	106
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	125.98092178
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	125.98092178
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0